SCHEMBL23708152

SCHEMBL23708152

NC(=O)c1cc(-c2ccncc2)ccc1N1CCCC1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 4/20 0.80
CDK9 P50750 1/20 0.80
KDM4E B2RXH2 2/20 0.60
MEN1 O00255 1/20 0.60
MAPT P10636 1/20 0.60
THRB P10828 1/20 0.60
ALOX15 P16050 1/20 0.60
GFER P55789 1/20 0.60
YWHAG P61981 1/20 0.60
KMT2A Q03164 1/20 0.60
HSD17B10 Q99714 1/20 0.60
HTT P42858 1/20 0.58
CHUK O15111 4/20 0.57
ALDH1A1 P00352 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
NPC1 O15118 1/20 0.51
ROCK2 O75116 4/20 0.48
MAP4K4 O95819 4/20 0.48
GSK3B P49841 4/20 0.48
CLK4 Q9HAZ1 4/20 0.48

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23707895 0.85 KDM4E (0.63) CDC7CDK9KDM4EMEN1MAPT
SCHEMBL23707919 0.84 MKNK1 (0.58) CDC7CDK9KDM4EMEN1MAPT
SCHEMBL23708616 0.82 CDC7 (0.59) CDC7CDK9KDM4EMAPTHTT
SCHEMBL23707892 0.79 KDM4E (0.55) CDC7CDK9KDM4EMEN1MAPT
SCHEMBL27946076 0.78 CHUK (0.59) CDC7CDK9CHUKROCK2MAP4K4
SCHEMBL23708489 0.78 KDM4E (0.53) CDC7CDK9KDM4EMEN1MAPT
SCHEMBL883907 0.77 CDC7 (0.58) CDC7CDK9KDM4EMEN1MAPT
SCHEMBL3627591 0.76 NPC1 (0.61) CDC7CDK9KDM4EMEN1MAPT
SCHEMBL17774819 0.75 KDM4E (1.00) CDC7CDK9KDM4EMEN1MAPT
SCHEMBL28281279 0.75 CDC7 (0.63) CDC7CDK9MEN1MAPTKMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021154966-A1 COMPOUNDS AND COMPOSITIONS FOR USE IN TREATING SKIN DISORDERS KAMARI PHARMA LTD. (IL) 2021-08-05 WO disclosed